ChemSpider 2D Image | 1-{2,5-Anhydro-4-[(phosphonooxy)methyl]-beta-D-lyxofuranosyl}-5-methyl-2,4(1H,3H)-pyrimidinedione | C11H15N2O9P

1-{2,5-Anhydro-4-[(phosphonooxy)methyl]-β-D-lyxofuranosyl}-5-methyl-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC11H15N2O9P
  • Average mass350.219 Da
  • Monoisotopic mass350.051514 Da
  • ChemSpider ID26354029

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1-{2,5-Anhydro-4-[(phosphonooxy)methyl]-β-D-lyxofuranosyl}-5-methyl-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 1-[2,5-anhydro-4-C-[(phosphonooxy)methyl]-β-D-lyxofuranosyl]-5-methyl- [ACD/Index Name]
1-{2,5-Anhydro-4-[(phosphonooxy)methyl]-β-D-lyxofuranosyl}-5-methyl-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
1-{2,5-Anhydro-4-[(phosphonooxy)méthyl]-β-D-lyxofuranosyl}-5-méthyl-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.630
Molar Refractivity: 70.2±0.3 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -0.52
ACD/LogD (pH 5.5): -3.82
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.76
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 165 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 88.4±3.0 dyne/cm
Molar Volume: 197.1±3.0 cm3

Click to predict properties on the Chemicalize site


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